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POU-163 / 18:5 n-3 / c3,c6,c9,c12,c15-18:3 |
Names: Methyl (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate; (3Z,6Z,9Z,12Z,15Z)-Octadeca-3,6,9,12,15-pentaenoic acid methyl ester; (Z,Z,Z,Z,Z)-3,6,9,12,15-Octadecapentaenoic acid methyl ester; 3Z,6Z,9Z,12Z,15Z-Octadecapentaenoic acid methyl ester; cis-3, cis-6, cis-9, cis-12, cis-15-Octadecapentaenoic acid methyl ester
Formula: C19H28O2
Molar mass: 288.429 Da
Monoisotopic mass: 288.209 Da
SMILES: CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC(=O)OC
InChI Key: BFGFXYUDHGJDNW-JEBPEJKESA-N
InChI: 1S/C19H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8,10-11,13-14,16-17H,3,6,9,12,15,18H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16-
Typical retention indexes:
- ECL on BPX70: 20.837
- ECL on Wax: 20.111
- ECL on DB225: 19.514
- ECL on 5% phenyl: 17.551
- KI on Wax: 2638
- KI on DB225: 2548
- KI on 5% phenyl: 2082
Names: (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoic acid; (Z,Z,Z,Z,Z)-3,6,9,12,15-Octadecapentaenoic acid; 3Z,6Z,9Z,12Z,15Z-Octadecapentaenoic acid; cis-3, cis-6, cis-9, cis-12, cis-15-Octadecapentaenoic acid
Formula: C18H26O2
Molar mass: 274.402 Da
SMILES: CC\C=C/C/C=C\C\C=C/C/C=C\C\C=C/CC(O)=O
InChI Key: LYJOUWBWJDKKEF-JLNKQSITSA-N
InChI: 1S/C18H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-,13-12-,16-15-
Lipid Maps code: LMFA01030360
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Data are acquired on Agilent 5972, 5973 and 5975 instruments at Nofima, Institute of Marine Research and University of Bergen. Molecular structures are created in Open Babel. |